SCHEMBL18907266

SCHEMBL18907266

c1ccc(-c2nc3cc4ccccc4cc3c3c2cc(-c2c4ccccc4c(-c4cc(-c5cccnc5)cc(-c5cccnc5)c4)c4ccccc24)c2ccccc23)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.41
ESR2 Q92731 5/20 0.41
CYP11B1 P15538 4/20 0.40
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
STAT1 P42224 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP11B2 P19099 3/20 0.39
CYP19A1 P11511 2/20 0.39
CYP17A1 P05093 1/20 0.39
DHODH Q02127 1/20 0.38
GPR84 Q9NQS5 1/20 0.38
CYP2A6 P11509 1/20 0.37
CYP2C9 P11712 3/20 0.36
CSNK2A2 P19784 1/20 0.35
CSNK2B P67870 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18907300 0.94 ESR1 (0.44) ESR1ESR2CYP11B1MAPTKDM4E
SCHEMBL17035127 0.91 DHODH (0.43) CYP11B1MAPTALDH1A1HPGDCYP11B2
SCHEMBL18907245 0.91 CYP11B1 (0.47) ESR1ESR2CYP11B1MAPTKDM4E
SCHEMBL17034986 0.87 DHODH (0.42) CYP11B1MAPTALDH1A1HPGDCYP19A1
SCHEMBL17034987 0.85 DHODH (0.42) CYP11B1MAPTALDH1A1HPGDCYP11B2
SCHEMBL18907270 0.85 ESR1 (0.49) ESR1ESR2MAPTKDM4EALDH1A1
SCHEMBL17034965 0.85 CYP11B1 (0.43) CYP11B1MAPTALDH1A1HPGDCYP19A1
SCHEMBL17035083 0.82 DHODH (0.41) CYP11B1MAPTKDM4EALDH1A1HPGD
SCHEMBL17034960 0.81 CYP11B1 (0.48) CYP11B1MAPTALDH1A1HPGDCYP11B2
SCHEMBL17035023 0.81 CYP11B1 (0.48) CYP11B1MAPTALDH1A1HPGDCYP11B2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170155057-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-01 US disclosed
US-20170155057-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170155057-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, OCIAD1, CCNT1 ESR1 114/4885ESR2 456/4885CYP11B1 201/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.